| Properties | Image |
MNX_ID | MNXM1371081 |
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reference | sabiorkM:27184 |
formula | C11H18N4O3 |
global charge | 0 |
mol weight | 254.29 |
InChIKey | VLDVBZICYBVQHB-UHFFFAOYSA-N |
InChI | InChI=1S/C11H18N4O3/c1-6(2)9(11(17)18)15-10(16)8(12)3-7-4-13-5-14-7/h4-6,8-9H,3,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18) |
SMILES | CC(C)C(N=C(O)C(N)CC1=CN=CN1)C(=O)O |
MNX internals
InChI (mnx) | InChI=1/C11H18N4O3/c1-6(2)9(11(17)18)15-10(16)8(12)3-7-4-13-5-14-7/h4-6,8-9H,3,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)/t8?,9? |
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SMILES (mnx) | [CH3:1][CH:6]([CH3:2])[CH:9]([C:11](=[O:17])[OH:18])[N:15]=[C:10]([CH:8]([CH2:3][C:7]1=[CH:4][N:13]=[CH:5][NH:14]1)[NH2:12])[OH:16] |
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